N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide

C13H20N2O2 — CID 110834301

IUPACN-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC(C)(C)CN
InChIInChI=1S/C13H20N2O2/c1-10-6-4-5-7-11(10)17-8-12(16)15-13(2,3)9-14/h4-7H,8-9,14H2,1-3H3,(H,15,16)
InChIKeyAOQLTGAQNDKNQQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.23
Rot. Bonds5

About N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide

N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 110834301) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide
PubChem CID110834301
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC(C)(C)CN
InChIInChI=1S/C13H20N2O2/c1-10-6-4-5-7-11(10)17-8-12(16)15-13(2,3)9-14/h4-7H,8-9,14H2,1-3H3,(H,15,16)
InChIKeyAOQLTGAQNDKNQQ-UHFFFAOYSA-N
XLogP1.23
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-(2-ethoxyphenoxy)acetamide
CID 119522316
N-(1-amino-2-methylpropan-2-yl)-2-(2-tert-butylphenoxy)acetamide
CID 119523420
N-(1-amino-2-methylpropan-2-yl)-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119523302
N-(1-amino-2-methylpropan-2-yl)-2-(2-ethylphenoxy)acetamide;hydrochloride
CID 119521833
N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide
CID 119524681
methyl 2-ethyl-2-[[2-(2-methylphenoxy)acetyl]amino]butanoate
CID 100627144
2-(2,3-dimethylphenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115968921
N-(1-amino-2-methylpropan-2-yl)-2-(4-benzoylphenoxy)acetamide
CID 119522817
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 8581903
N-(1-amino-2-methylpropan-2-yl)-2-(2,4,5-trichlorophenoxy)acetamide;hydrochloride
CID 119524297
N-(1-amino-2-methylpropan-2-yl)-3-(2-bromophenoxy)propanamide
CID 119521510
2-hydroxy-2-methyl-3-[[2-(2-methylphenoxy)acetyl]amino]propanoic acid
CID 66174192

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide (CID 110834301) is N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)NC(C)(C)CN.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is AOQLTGAQNDKNQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-6-4-5-7-11(10)17-8-12(16)15-13(2,3)9-14/h4-7H,8-9,14H2,1-3H3,(H,15,16).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide?
N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 110834301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).